Information card for entry 1507710

Structure parameters

• Formula: C14 H14 Cl4 Cu2 N14
• Calculated formula: C14 H14 Cl4 Cu2 N14
• SMILES: [Cu]1(Cl)(Cl)([Cl][Cu]2(Cl)[N](Cc3ccc(c[n]23)CN=N#N)=N#N)[n]2c(ccc(CN=N#N)c2)C[N]1=N#N
• Title of publication: Chemoselective sequential "click" ligation using unsymmetrical bisazides.
• Authors of publication: Yuan, Zhao; Kuang, Gui-Chao; Clark, Ronald J.; Zhu, Lei
• Journal of publication: Organic letters
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 2590 - 2593
• a: 7.9368 ± 0.001 Å
• b: 31.757 ± 0.004 Å
• c: 9.0741 ± 0.0011 Å
• α: 90°
• β: 101.11 ± 0.001°
• γ: 90°
• Cell volume: 2244.3 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0318
• Residual factor for significantly intense reflections: 0.0295
• Weighted residual factors for significantly intense reflections: 0.0679
• Weighted residual factors for all reflections included in the refinement: 0.0691
• Goodness-of-fit parameter for all reflections included in the refinement: 0.971
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No